1,6-Anhydro-4-O-p-toluenesufonyl-b-D-glucopyranose supplier

Name
1,6-ANHYDRO-4-O-TOLUENESUFONYL-BETA-D-GLUCOPYRANOSE
EINECS
CAS No. 23643-29-0
Article Data4
CAS DataBase
Density 1.557 g/cm³
Solubility
Melting Point 116-117°C
Formula C₁₃H₁₆O₇S
Boiling Point 547.931 °C at 760 mmHg
Molecular Weight 316.33
Flash Point 285.179 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms Levoglucosan,4-p-toluenesulfonate (7CI,8CI);1,6-Anhydro-4-O-toluenesufonyl-beta-D-glucopyranose;(1R,2S,3R,4R,5R)-3,4-Dihydroxy-6,8-dioxabicyclo[3.2.1]oct-2-yl 4-methylbenzenesulfonate;
PSA 110.67000
LogP 0.62660

1,6-Anhydro-4-O-p-toluenesufonyl-b-D-glucopyranose Specification

The b-D-Glucopyranose, 1,6-anhydro-,4-(4-methylbenzenesulfonate) with CAS registry number of 23643-29-0 is also known as 1,6-Anhydro-4-O-p-toluenesufonyl-b-D-glucopyranose. The systematic name is (1R,2S,3R,4R,5R)-3,4-Dihydroxy-6,8-dioxabicyclo[3.2.1]oct-2-yl 4-methylbenzenesulfonate. In addition, the formula is C₁₃H₁₆O₇S and the molecular weight is 316.33.

Physical properties about b-D-Glucopyranose, 1,6-anhydro-,4-(4-methylbenzenesulfonate) are: (1)ACD/LogP: 0.39; (2)ACD/LogD (pH 5.5): 1; (3)ACD/LogD (pH 7.4): 1; (4)ACD/BCF (pH 5.5): 4; (5)ACD/BCF (pH 7.4): 4; (6)ACD/KOC (pH 5.5): 86; (7)ACD/KOC (pH 7.4): 86; (8)#H bond acceptors: 7; (9)#H bond donors: 2; (10)#Freely Rotating Bonds: 5; (11)Index of Refraction: 1.628; (12)Molar Refractivity: 72.076 cm³; (13)Molar Volume: 203.197 cm³; (14)Surface Tension: 70.054 dyne/cm; (15)Density: 1.557 g/cm³; (16)Flash Point: 285.179 °C; (17)Enthalpy of Vaporization: 87.07 kJ/mol; (18)Boiling Point: 547.931 °C at 760 mmHg.

You can still convert the following datas into molecular structure:
1. SMILES: O=S(=O)(O[C@H]1[C@H](O)[C@@H](O)[C@H]2O[C@@H]1CO2)c3ccc(cc3)C
2. InChI: InChI=1/C13H16O7S/c1-7-2-4-8(5-3-7)21(16,17)20-12-9-6-18-13(19-9)11(15)10(12)14/h2-5,9-15H,6H2,1H3/t9-,10-,11-,12-,13-/m1/s1
3. InChIKey: UQADBXIDJFBONH-SYLRKERUBQ
4. Std. InChI: InChI=1S/C13H16O7S/c1-7-2-4-8(5-3-7)21(16,17)20-12-9-6-18-13(19-9)11(15)10(12)14/h2-5,9-15H,6H2,1H3/t9-,10-,11-,12-,13-/m1/s1
5. Std. InChIKey: UQADBXIDJFBONH-SYLRKERUSA-N

Product Name

1,6-ANHYDRO-4-O-TOLUENESUFONYL-BETA-D-GLUCOPYRANOSE

1,6-Anhydro-4-O-p-toluenesufonyl-b-D-glucopyranose Specification

Related Products

Hot Products